update version tags for feature release
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.TH LAMMPS "1" "7 February 2024" "2024-02-07"
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.TH LAMMPS "1" "17 April 2024" "2024-04-17"
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.SH NAME
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.SH NAME
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.B LAMMPS
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.B LAMMPS
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\- Molecular Dynamics Simulator. Version 7 February 2024
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\- Molecular Dynamics Simulator. Version 17 April 2024
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.SH SYNOPSIS
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.SH SYNOPSIS
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.B lmp
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.B lmp
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@ -297,7 +297,7 @@ the chapter on errors in the
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manual gives some additional information about error messages, if possible.
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manual gives some additional information about error messages, if possible.
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.SH COPYRIGHT
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.SH COPYRIGHT
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© 2003--2022 Sandia Corporation
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© 2003--2024 Sandia Corporation
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This package is free software; you can redistribute it and/or modify
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This package is free software; you can redistribute it and/or modify
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it under the terms of the GNU General Public License version 2 as
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it under the terms of the GNU General Public License version 2 as
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@ -24,7 +24,7 @@ Examples
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Description
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Description
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"""""""""""
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"""""""""""
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The *cosine/squared/restricted* angle style uses the potential
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The *cosine/squared/restricted* angle style uses the potential
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@ -22,7 +22,7 @@ Examples
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Description
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Description
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"""""""""""
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"""""""""""
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The *cosine/squared/restricted* dihedral style uses the potential
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The *cosine/squared/restricted* dihedral style uses the potential
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@ -435,7 +435,7 @@ molecule.
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----------
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----------
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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new keyword *append*
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new keyword *append*
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The *file* or *append* keywords allow a filename to be specified. If
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The *file* or *append* keywords allow a filename to be specified. If
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@ -319,7 +319,7 @@ on. The default is step 0. Often input values can be 0.0 at time 0,
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so setting *start* to a larger value can avoid including a 0.0 in
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so setting *start* to a larger value can avoid including a 0.0 in
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a running or windowed histogram.
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a running or windowed histogram.
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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new keyword *append*
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new keyword *append*
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The *file* or *append* keywords allow a filename to be specified. If
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The *file* or *append* keywords allow a filename to be specified. If
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@ -272,7 +272,7 @@ are effectively constant or are simply current values (e.g., they are
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being written to a file with other time-averaged values for purposes
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being written to a file with other time-averaged values for purposes
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of creating well-formatted output).
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of creating well-formatted output).
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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new keyword *append*
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new keyword *append*
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The *file* or *append* keywords allow a filename to be specified. If
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The *file* or *append* keywords allow a filename to be specified. If
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@ -70,7 +70,7 @@ re-balancing is performed periodically during the simulation. To
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perform "static" balancing, before or between runs, see the
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perform "static" balancing, before or between runs, see the
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:doc:`balance <balance>` command.
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:doc:`balance <balance>` command.
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The *report* balance style only computes the load imbalance but
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The *report* balance style only computes the load imbalance but
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does not attempt any re-balancing. This way the load imbalance
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does not attempt any re-balancing. This way the load imbalance
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@ -69,7 +69,7 @@ Examples
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Description
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Description
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"""""""""""
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"""""""""""
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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This fix is an extension of the :doc:`fix deform <fix_deform>`
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This fix is an extension of the :doc:`fix deform <fix_deform>`
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command, which allows all of its options to be used as well as new
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command, which allows all of its options to be used as well as new
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@ -253,7 +253,7 @@ be enabled if any electrode particle has the same type as any
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electrolyte particle (which would be unusual in a typical simulation)
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electrolyte particle (which would be unusual in a typical simulation)
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and the fix will issue an error in that case.
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and the fix will issue an error in that case.
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The keyword *qtotal* causes *fix electrode/conp* and *fix
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The keyword *qtotal* causes *fix electrode/conp* and *fix
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electrode/thermo* to add an overall potential to all electrodes so that
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electrode/thermo* to add an overall potential to all electrodes so that
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@ -267,7 +267,7 @@ and since *symm on* constrains the total charge of all electrodes to be
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zero, either option is incompatible with the *qtotal* keyword (even if
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zero, either option is incompatible with the *qtotal* keyword (even if
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*qtotal* is set to zero).
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*qtotal* is set to zero).
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The keyword *eta* takes the name of a custom double vector defined via
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The keyword *eta* takes the name of a custom double vector defined via
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fix property/atom. The values will be used instead of the standard eta
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fix property/atom. The values will be used instead of the standard eta
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@ -40,7 +40,7 @@ Examples
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Description
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Description
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"""""""""""
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"""""""""""
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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This fix implements flow boundary conditions (FBC) introduced in
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This fix implements flow boundary conditions (FBC) introduced in
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:ref:`(Pavlov1) <fbc-Pavlov1>` and :ref:`(Pavlov2) <fbc-Pavlov2>`.
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:ref:`(Pavlov1) <fbc-Pavlov1>` and :ref:`(Pavlov2) <fbc-Pavlov2>`.
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@ -576,7 +576,7 @@ changed to *no* since the *sort* keyword does not support *host* mode. Not
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all fix styles with extra atom data support *device* mode and in that case
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all fix styles with extra atom data support *device* mode and in that case
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a warning will be given and atom sorting will run in *no* mode instead.
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a warning will be given and atom sorting will run in *no* mode instead.
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The *atom/map* keyword determines whether the host or device builds the
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The *atom/map* keyword determines whether the host or device builds the
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atom_map, see the :doc:`atom_modify map <atom_modify>` command. The
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atom_map, see the :doc:`atom_modify map <atom_modify>` command. The
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@ -46,7 +46,7 @@ Used in input scripts:
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Description
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Description
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"""""""""""
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"""""""""""
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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Pair style *pedone* computes the **non-Coulomb** interactions of the Pedone
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Pair style *pedone* computes the **non-Coulomb** interactions of the Pedone
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(or PMMCS) potential :ref:`(Pedone) <Pedone>` which combines Coulomb
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(or PMMCS) potential :ref:`(Pedone) <Pedone>` which combines Coulomb
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@ -28,7 +28,7 @@ Example input scripts available: examples/threebody/
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Description
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Description
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"""""""""""
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"""""""""""
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.. versionadded:: TBD
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.. versionadded:: 17Apr2024
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The *rebomos* pair style computes the interactions between molybdenum
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The *rebomos* pair style computes the interactions between molybdenum
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and sulfur atoms :ref:`(Stewart) <Stewart>` utilizing an adaptive
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and sulfur atoms :ref:`(Stewart) <Stewart>` utilizing an adaptive
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@ -1,2 +1 @@
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#define LAMMPS_VERSION "7 Feb 2024"
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#define LAMMPS_VERSION "17 Apr 2024"
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#define LAMMPS_UPDATE "Development"
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